[gmx-users] g_cluster[output]
Osmany Guirola Cruz
osmany.guirola at cigb.edu.cu
Tue May 6 16:33:01 CEST 2003
Hi
I am doing cluster analysis of my simulation. I use gromos method, and
analyse the backbone, but i need that the output(clusters.pdb) was the entire
peptide. First time i did this
group for least squares fit 4(backbone)
group for output 4(backbone)
and i found 4 clusters.
next time i did this
group for least squares fit 4(backbone)
group for output 1(protein) (this is really that i need)
and i found 15 clusters
WHY? i just change "group for output" i think that the result must be the
same(i don't change the trajectory files)
What can i do?
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